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Home > Imidazoles > 89075-46-7
89075-46-7 | 1H-Imidazo[4,5-c]pyridine, 2-(3-nitrophenyl)-
CAS No: 89075-46-7 Catalog No: AG0087DF MDL No:
Product Description
Catalog Number:
AG0087DF
Chemical Name:
1H-Imidazo[4,5-c]pyridine, 2-(3-nitrophenyl)-
CAS Number:
89075-46-7
Molecular Formula:
C12H8N4O2
Molecular Weight:
240.2175
IUPAC Name:
2-(3-nitrophenyl)-3H-imidazo[4,5-c]pyridine
InChI:
InChI=1S/C12H8N4O2/c17-16(18)9-3-1-2-8(6-9)12-14-10-4-5-13-7-11(10)15-12/h1-7H,(H,14,15)
InChI Key:
GYZSMDFIKSQQNB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1nc2c([nH]1)ccnc2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.222g/mol
Monoisotopic Mass:
240.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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